Basic information
- Standard SMILES
O=c1ccoc2cc(O)ccc12- InChIKey
WVJCRTSTRGRJJT-UHFFFAOYSA-N- Molecular formula
- C9H6O3
- Average molar mass
- 162.14 g/mol
- Monoisotopic mass
- 162.03169405
Overview
7-Hydroxy-4-chromone is a member of chromones.
Names & identifiers
- Preferred name
- 7-Hydroxy-4-benzopyrone
- IUPAC
- 7-hydroxychromen-4-one
- English name
- 7-hydroxy-4-benzopyrone
- Molecular formula
- C9H6O3
- Molecular weight
- 162.14
Names & synonyms
59887-89-77-hydroxychromen-4-one7-Hydroxy-4-benzopyrone7-HydroxychromoneEINECS 261-973-7DTXSID40208604RefChem:546565DTXCID50131095261-973-77-hydroxy-4H-chromen-4-one7-Hydroxy-4-chromoneMFCD00209371
Show more names
7-Hydroxy-4-chroMone 97%7-Hydroxybenzopyran-4-one7-hydroxy-1-benzopyran-4-one7-Hydroxy-4H-chromen-4-one, 10 mM in DMSO7-Hydroxy-4H-1-benzopyran-4-one, 7-Hydroxybenzopyran-4-one
7-Hydroxy-4H-1-benzopyran-4-one7-Hydroxy-chromen-4-one7-hydroxy-4H-4-chromenoneCHEMBL58827BDBM50077313SB22724CS-0034320F6170-0105
Database identifiers
- CAS
59887-89-7- PubChem CID
- 5409279
- DTXSID
DTXSID40208604- ChEMBL
CHEMBL58827- ChEBI
CHEBI:192676- EC Number
- 261-973-7
- Nikkaji
- J228.098A
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 222
Experimental & physicochemical properties
LogP1.44
Physicochemical properties
- Melting point
- 215 · 215-220 °C
- Boiling point
- 345.4 · 345.4±42.0 °C(Predicted)
- Density
- 1.403 · 1.403±0.06 g/cm3(Predicted)
- storage temp.
- -20 °C · Store at -20°C
- solubility
- 150 mg/mL · DMSO : 150 mg/mL (925.13 mM)
- form
- Solid
- pka
- 7.07 · 7.07±0.20(Predicted)
- color
- Pink to red
- InChI
- 1S/C9H6O3/c10-6-1-2-7-8(11)3-4-12-9(7)5-6/h1-5,10H
- InChIKey
- WVJCRTSTRGRJJT-UHFFFAOYSA-N
- SMILES
- Oc1ccc2C(=O)C=COc2c1
- UNSPSC Code
- 12352100 · 12352100
- NACRES
- 22 · NA.22
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302
- Precautionary statements
- 280 · P280-P305+P351+P338
- PPE
- 95 · dust mask type N95 (US), Eyeshields, Gloves
- Hazard Codes
- Xn
- Risk Statements
- 22 · 22
- WGK Germany
- 3 · 3
- HS Code
- 2932990090 · 2932990090
- Storage Class
- 11 · 11 - Combustible Solids
- Hazard Classifications
- 4 Oral · Acute Tox. 4 Oral
Safety & regulation
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- PPE
- dust mask type N95 (US), Eyeshields, Gloves
- wgk
- 3
- hs_code
- 2932990090
- risk_code
- 22
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xn
- Storage Class
- 11 - Combustible Solids
- Hazard statements
- H302
- Hazard Classifications
- Acute Tox. 4 Oral
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Pharmacology
Metabolism/Metabolites7-Hydroxychromone has known human metabolites that include 7-Hydroxychromone, 7-hydroxy-glucuronide.
Applications
Uses7-Hydroxy-4-chromone, is a 4-oxo-4H-1-benzopyran derivative which can inhibit Src kinase with an IC50 of
Upstream & downstream products
Downstream products
Suppliers50 total
南京世洲生物科技有限公司025-85560043 15850508050 · [email protected]
衢州润东化工有限公司0570-8789886 18892685668 · [email protected]
銘瑞集團有限公司17318633522 · [email protected]
北京福源坊科技有限公司010-57903446 15869909019 · [email protected]
上海纯优生物科技有限公司18302135232 18302135232 · [email protected]
成都彼样生物科技有限公司18108052721 · [email protected]
Sichuan Biosynce Pharmatech Co., Ltd.[email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
苏州市森菲达化工有限公司18796480002 18796480002 · [email protected]
Suzhou ARTK Medchem Co., Ltd.+86-18168183658 · [email protected]
云南西力生物技术股份有限公司0871-65217109 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
浙江珲达生物科技有限公司0571-89903022 18679456698 · [email protected]
韶远科技（上海）有限公司021-50795510 4000665055 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
南京药石科技股份有限公司025-86918202 4000255188 · [email protected]
United Life Science020-82099279 18988941402 · [email protected]
銳迪國際科技有限公司18024082417 · [email protected]
武汉市皇臻生物化工有限公司13795480948 · [email protected]
南京药石科技股份有限公司4000255188 · [email protected]
佛山宝诺生物科技有限公司0757-85921206 18520245316 · [email protected]
山东李比希生物医药科技有限公司15318973357; 15318973357 · [email protected]
上海源叶生物科技有限公司13636370518 · [email protected]
成都海品信医药科技有限公司85114309 18982182443 · [email protected]
上海渤腾医药科技有限公司13524892556 · [email protected]
台州南峰药物研究所[email protected] 18616377689 · [email protected]
广州爱纯医药科技有限公司020-39119399 18927568969 · [email protected]
陕西麟邦实业有限公司17709134430 · [email protected]
河南赢创生物科技有限公司15672878902 · [email protected]
PT CHEM GROUP LIMITED+86-85511178; +86-85511178 · [email protected]
上海毕得医药科技股份有限公司400-164-7117 18317119277 · [email protected]
雷丁试剂0510-85629785 18013409632 · [email protected]
天津普西唐生物医药科技有限公司010-60605840 · [email protected]
陕西缔都医药化工有限公司029-81024372 17792795018 · [email protected]
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]
江苏倍达医药科技有限公司0512-63009836 18994340901 · [email protected]
南兴化工（江苏）有限公司0512-66387035 18662433356 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
BOC Sciences16314854226; +8616314854226 · [email protected]
上海谱振生物科技有限公司4001650900 13817534909 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
R&D Scientific Inc.+1-2266000236 · [email protected]
sgtlifesciences pvt ltd+91-8790379245 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
Guangzhou Yuheng Pharmaceutical Technology Co., Ltd+8613580539051 · [email protected]
上海西格生物科技有限公司021-57810052 18930344717 · [email protected]
上海麦克林生化科技股份有限公司50706066 15221275939 · [email protected]
上海颖心实验室设备有限公司021-021-59178156 15300768757 · [email protected]
上海煜柯化学品有限公司13391486464 · [email protected]
Additional notes
DefinitionChEBI: 7-Hydroxy-4-chromone is a member of chromones.
Related reactions
19 records
Linked notes
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